CAS No.6627-89-0,tert-Butyl phenyl carbonate Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	6627-89-0
Name:	tert-Butyl phenyl carbonate
Article Data:	22

Formula:	C₁₁H₁₄O₃
Molecular Weight:	194.23
Synonyms:	Carbonicacid, tert-butyl phenyl ester (6CI);1-tert-Butoxycarbonyloxybenzene;NSC60248;Phenyl tert-butyl carbonate;Phenyl tert-butyl carbonate;
EINECS:	229-601-8
Density:	1.061 g/cm³
Boiling Point:	259.8 °C at 760 mmHg
Flash Point:	97 °C
Solubility:	Slightly soluble in water.
Safety:	23-24/25
PSA:	35.53000
LogP:	3.00050

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Specification

The tert-Butyl phenyl carbonate with its cas register number is 6627-89-0. It also can be called as Carbonic acid,1,1-dimethylethyl phenyl ester and the IUPAC Name about this chemical is tert-butyl phenyl carbonate. It belongs to the following product categories, such as Carbonates, Carbonyl Compounds, Organic Building Blocks and so on. When you are using it, please not breathe vapour and avoid contact with skin and eyes.

Physical properties about tert-Butyl phenyl carbonate are: (1)ACD/LogP: 2.72; (2)ACD/LogD (pH 5.5): 2.72; (3)ACD/LogD (pH 7.4): 2.72; (4)ACD/BCF (pH 5.5): 68.81; (5)ACD/BCF (pH 7.4): 68.81; (6)ACD/KOC (pH 5.5): 719.47; (7)ACD/KOC (pH 7.4): 719.47; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 35.53Å²; (11)Index of Refraction: 1.493; (12)Molar Refractivity: 53.2 cm³; (13)Molar Volume: 182.9 cm³; (14)Polarizability: 21.09x10^-24cm³; (15)Surface Tension: 34.3 dyne/cm; (16)Enthalpy of Vaporization: 49.75 kJ/mol; (17)Vapour Pressure: 0.0127 mmHg at 25°C.

Uses of tert-Butyl phenyl carbonate: it can be used to produce hydrazinecarboxylic acid tert-butyl ester. It will need reagent hydrazine hydrate.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)(C)OC(=O)OC1=CC=CC=C1
(2)InChI: InChI=1S/C11H14O3/c1-11(2,3)14-10(12)13-9-7-5-4-6-8-9/h4-8H,1-3H3
(3)InChIKey: UXWVQHXKKOGTSY-UHFFFAOYSA-N